1-(phenylmethyl)-4-thiophen-2-ylsulfonyl-piperazin-1-ium chloride

Systemtic Name: 1-(phenylmethyl)-4-thiophen-2-ylsulfonyl-piperazin-1-ium chloride Openeye Name: 1-benzyl-4-(2-thienylsulfonyl)piperazin-1-ium chloride CAS Name: 1-(phenylmethyl)-4-thiophen-2-ylsulfonylpiperazin-1-ium chloride IUPAC Name: 1-benzyl-4-thiophen-2-ylsulfonylpiperazin-1-ium chloride Traditional Name: 1-benzyl-4-(2-thienylsulfonyl)piperazin-1-ium chloride Formula: C15H19ClN2O2S2 MolecularWeight: 358.90656

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CS3.[Cl-]

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CS3.[Cl-]

InChI

InChI=1S/C15H18N2O2S2.ClH/c18-21(19,15-7-4-12-20-15)17-10-8-16(9-11-17)13-14-5-2-1-3-6-14;/h1-7,12H,8-11,13H2;1H